smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C(Nc1cccc(C[NH+]2CCOCC2)c1)c1cnn(-c2ccc(F)cc2F)c1	ZINC000161003600	211341705	/nfs/dbraw/zinc/34/17/05/211341705.db2.gz	MHAGWFDUPCJPDU-UHFFFAOYSA-N	1	2	398.413	3.235	40	70		GGIBLO
O=C(C[N@H+]1C[C@H]2C[C@H](Cn3c(=O)cccc32)C1)c1ccc(Cl)cc1Cl	ZINC000217559246	565897225	/nfs/dbraw/zinc/89/72/25/565897225.db2.gz	CDXCCFHMOSTCAV-QWHCGFSZSA-N	1	2	377.271	3.457	40	70		GGIBLO
O=C(C[N@@H+]1C[C@H]2C[C@H](Cn3c(=O)cccc32)C1)c1ccc(Cl)cc1Cl	ZINC000217559246	565897230	/nfs/dbraw/zinc/89/72/30/565897230.db2.gz	CDXCCFHMOSTCAV-QWHCGFSZSA-N	1	2	377.271	3.457	40	70		GGIBLO
O=C(c1ccc(Cl)cc1)[C@@H]1[C@H]2C(=O)N(c3ccccc3)C(=O)[C@@H]2[C@H]2CCC[N@@H+]21	ZINC000217450403	570316170	/nfs/dbraw/zinc/31/61/70/570316170.db2.gz	LSGCURXUUXADFZ-YRXWBPOGSA-N	1	2	394.858	3.175	40	70		GGIBLO
O=C(c1ccc(Cl)cc1)[C@@H]1[C@H]2C(=O)N(c3ccccc3)C(=O)[C@@H]2[C@H]2CCC[N@H+]21	ZINC000217450403	570316171	/nfs/dbraw/zinc/31/61/71/570316171.db2.gz	LSGCURXUUXADFZ-YRXWBPOGSA-N	1	2	394.858	3.175	40	70		GGIBLO
O=C(NCCCN1CCCc2ccccc21)c1ccc(C[NH+]2CCOCC2)cc1	ZINC000218077857	136203515	/nfs/dbraw/zinc/20/35/15/136203515.db2.gz	LEOOEHSIYMSXCD-UHFFFAOYSA-N	1	2	393.531	3.092	40	70		GGIBLO
Cc1ccc(N2C(=O)[C@@H]3[C@H]4CCC[N@@H+]4[C@@H](C(=O)c4ccccc4)[C@H]3C2=O)cc1C	ZINC000217478608	570316531	/nfs/dbraw/zinc/31/65/31/570316531.db2.gz	ZHQNWZMABXGLTE-MXEMCNAFSA-N	1	2	388.467	3.139	40	70		GGIBLO
Cc1ccc(N2C(=O)[C@@H]3[C@H]4CCC[N@H+]4[C@@H](C(=O)c4ccccc4)[C@H]3C2=O)cc1C	ZINC000217478608	570316534	/nfs/dbraw/zinc/31/65/34/570316534.db2.gz	ZHQNWZMABXGLTE-MXEMCNAFSA-N	1	2	388.467	3.139	40	70		GGIBLO
CCc1ccc(N2C(=O)[C@@H]3[C@H]4CCC[N@@H+]4[C@H](C(=O)c4ccccc4)[C@H]3C2=O)cc1	ZINC000217574489	570318436	/nfs/dbraw/zinc/31/84/36/570318436.db2.gz	BRHTWTJGFOAPDG-CGXNFDGLSA-N	1	2	388.467	3.084	40	70		GGIBLO
CCc1ccc(N2C(=O)[C@@H]3[C@H]4CCC[N@H+]4[C@H](C(=O)c4ccccc4)[C@H]3C2=O)cc1	ZINC000217574489	570318439	/nfs/dbraw/zinc/31/84/39/570318439.db2.gz	BRHTWTJGFOAPDG-CGXNFDGLSA-N	1	2	388.467	3.084	40	70		GGIBLO
Cc1cc(C)cc(N2C(=O)[C@@H]3[C@H]4CCC[N@@H+]4[C@H](C(=O)c4ccccc4)[C@H]3C2=O)c1	ZINC000217472866	570316496	/nfs/dbraw/zinc/31/64/96/570316496.db2.gz	RXFYHRRDRDQGTJ-CGXNFDGLSA-N	1	2	388.467	3.139	40	70		GGIBLO
Cc1cc(C)cc(N2C(=O)[C@@H]3[C@H]4CCC[N@H+]4[C@H](C(=O)c4ccccc4)[C@H]3C2=O)c1	ZINC000217472866	570316499	/nfs/dbraw/zinc/31/64/99/570316499.db2.gz	RXFYHRRDRDQGTJ-CGXNFDGLSA-N	1	2	388.467	3.139	40	70		GGIBLO
Cc1ccc(N2C(=O)[C@H]3[C@H](C(=O)c4ccccc4)[N@H+]4CCC[C@@H]4[C@H]3C2=O)cc1C	ZINC000217478444	570316542	/nfs/dbraw/zinc/31/65/42/570316542.db2.gz	ZHQNWZMABXGLTE-XRXFAXGQSA-N	1	2	388.467	3.139	40	70		GGIBLO
Cc1ccc(N2C(=O)[C@H]3[C@H](C(=O)c4ccccc4)[N@@H+]4CCC[C@@H]4[C@H]3C2=O)cc1C	ZINC000217478444	570316546	/nfs/dbraw/zinc/31/65/46/570316546.db2.gz	ZHQNWZMABXGLTE-XRXFAXGQSA-N	1	2	388.467	3.139	40	70		GGIBLO